SEQ2FUN

BioLiP

PDB CCD ID: RU2
Number of entries in BioLiP: 2
Chemical formula: C H10 O6 Ru
InChI: InChI=1S/CO.5H2O.Ru/c1-2;;;;;;/h;5*1H2;/q+1;;;;;;+5
InChIKey: XGGVDGPXQXWURT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C(#[O+])[Ru]([OH2+])([OH2+])([OH2+])([OH2+])[OH2+]
CACTVS 3.385[OH2+][Ru]([OH2+])([OH2+])([OH2+])([OH2+])C#[O+]
Name:pentakis(oxidaniumyl)-(oxidaniumylidynemethyl)ruthenium
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).